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127169-00-0

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Basic Information
CAS No.: 127169-00-0
Name: (2-Benzylisoindolin-4-yl)methanamine
Molecular Structure:
Molecular Structure of 127169-00-0 ((2-Benzylisoindolin-4-yl)methanamine)
Formula: C16H18 N2
Molecular Weight: 238.33
Synonyms: 2-Benzyl-4-(aminomethyl)isoindoline
Density: 1.146g/cm3
Boiling Point: 359°Cat760mmHg
Flash Point: 155.2°C
PSA: 29.26000
LogP: 3.29930
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Chemistry

Molecular Structure of (2-Benzylisoindolin-4-yl)methanamine (CAS No.127169-00-0):

Molecular Formula: C16H18N2
Molecular Weight: 238.3275
CAS No: 127169-00-0
H bond acceptors: 2
H bond donors: 2
Freely Rotating Bonds: 4
Polar Surface Area: 29.26 Å2
Index of Refraction: 1.641
Molar Refractivity: 75 cm3
Molar Volume: 207.8 cm3
Surface Tension: 52.9 dyne/cm
Density: 1.146 g/cm3
Flash Point: 155.2 °C
Enthalpy of Vaporization: 60.45 kJ/mol
Boiling Point: 359 °C at 760 mmHg
Vapour Pressure: 2.45E-05 mmHg at 25°C
InChI: InChI=1/C16H18N2/c17-9-14-7-4-8-15-11-18(12-16(14)15)10-13-5-2-1-3-6-13/h1-8H,9-12,17H2
InChIKey: UXAZXMXGESTEHL-UHFFFAOYAQ
Std. InChI: InChI=1S/C16H18N2/c17-9-14-7-4-8-15-11-18(12-16(14)15)10-13-5-2-1-3-6-13/h1-8H,9-12,17H2
Std. InChIKey: UXAZXMXGESTEHL-UHFFFAOYSA-N
Product Categories: Chiral chemicals

Specification

  (2-Benzylisoindolin-4-yl)methanamine (CAS No.127169-00-0), its synonyms are 1-(2-Benzyl-2,3-dihydro-1H-isoindol-4-yl)methanamine ; 1H-isoindole-4-methanamine, 2,3-dihydro-2-(phenylmethyl)- ; N-BOC-(2-Benzylisoindolin-4-yl)methanamine .